N-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-2-nitro-aniline hydrochloride

Systemtic Name: N-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-2-nitro-aniline hydrochloride Openeye Name: N-[3-(4-benzhydrylpiperazin-1-yl)propyl]-2-nitro-aniline hydrochloride CAS Name: N-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-2-nitroaniline hydrochloride IUPAC Name: N-[3-(4-benzhydrylpiperazin-1-yl)propyl]-2-nitroaniline hydrochloride Traditional Name: 3-(4-benzhydrylpiperazino)propyl-(2-nitrophenyl)amine hydrochloride Formula: C26H31ClN4O2 MolecularWeight: 467.00294

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC2=CC=CC=C2[N+](=O)[O-])C(C3=CC=CC=C3)C4=CC=CC=C4.Cl

Isomeric SMILES

C1CN(CCN1CCCNC2=CC=CC=C2[N+](=O)[O-])C(C3=CC=CC=C3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C26H30N4O2.ClH/c31-30(32)25-15-8-7-14-24(25)27-16-9-17-28-18-20-29(21-19-28)26(22-10-3-1-4-11-22)23-12-5-2-6-13-23;/h1-8,10-15,26-27H,9,16-21H2;1H